SCHEMBL9857733

SCHEMBL9857733

CCCCCCCC/C=C/CCCCCCCC(=O)Nc1c(OCC)cc(OCC)cc1OCC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.55
SOAT2 O75908 1/20 0.53
SOAT1 P35610 1/20 0.53
PSMB11 A5LHX3 1/20 0.52
PSMA7 O14818 1/20 0.52
PSMB1 P20618 1/20 0.52
PSMA1 P25786 1/20 0.52
PSMA2 P25787 1/20 0.52
PSMA3 P25788 1/20 0.52
PSMA4 P25789 1/20 0.52
PSMB8 P28062 1/20 0.52
PSMB9 P28065 1/20 0.52
PSMA5 P28066 1/20 0.52
PSMB4 P28070 1/20 0.52
PSMB6 P28072 1/20 0.52
PSMB5 P28074 1/20 0.52
PSMB10 P40306 1/20 0.52
PSMB3 P49720 1/20 0.52
PSMB2 P49721 1/20 0.52
PSMA6 P60900 1/20 0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9857735 1.00 CNR1 (0.55) CNR1SOAT2SOAT1PSMB11PSMA7
SCHEMBL10554782 1.00 CNR1 (0.55) CNR1SOAT2SOAT1PSMB11PSMA7
SCHEMBL10552772 0.98 CNR1 (0.53) CNR1SOAT2SOAT1PSMB11PSMA7
SCHEMBL9857751 0.98 CNR1 (0.53) CNR1SOAT2SOAT1PSMB11PSMA7
SCHEMBL9857759 0.98 CNR1 (0.53) CNR1SOAT2SOAT1PSMB11PSMA7
SCHEMBL9857267 0.91 EPHX2 (0.49) CNR1CNR2EPHX2FAAHALDH1A1
SCHEMBL10553155 0.91 EPHX2 (0.49) CNR1CNR2EPHX2FAAHALDH1A1
SCHEMBL9857269 0.91 EPHX2 (0.49) CNR1CNR2EPHX2FAAHALDH1A1
SCHEMBL9498573 0.84 CNR1 (0.66) CNR1SOAT1CNR2EPHX2FAAH
SCHEMBL9498564 0.84 CNR1 (0.66) CNR1SOAT1CNR2EPHX2FAAH

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0295637-B1 LIPID REGULATING COMPOSITIONS WARNER-LAMBERT COMPANY (US) 1991-09-25 EP claimed
EP-0295637-A2 Lipid regulating compositions WARNER-LAMBERT COMPANY (US) 1988-12-21 EP claimed
EP-0295637-B1 LIPID REGULATING COMPOSITIONS WARNER-LAMBERT COMPANY (US) 1991-09-25 EP disclosed
EP-0295637-A2 Lipid regulating compositions WARNER-LAMBERT COMPANY (US) 1988-12-21 EP disclosed